ChemSpider 2D Image | 1-(Bicyclo[4.1.0]hepta-1,3,5-trien-3-ylethynyl)naphthalene | C19H12

1-(Bicyclo[4.1.0]hepta-1,3,5-trien-3-ylethynyl)naphthalene

  • Molecular FormulaC19H12
  • Average mass240.299 Da
  • Monoisotopic mass240.093903 Da
  • ChemSpider ID92122035

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-(Bicyclo[4.1.0]hepta-1,3,5-trien-3-ylethinyl)naphthalin [German] [ACD/IUPAC Name]
1-(Bicyclo[4.1.0]hepta-1,3,5-trién-3-yléthynyl)naphtalène [French] [ACD/IUPAC Name]
1-(Bicyclo[4.1.0]hepta-1,3,5-trien-3-ylethynyl)naphthalene [ACD/IUPAC Name]
Bicyclo[4.1.0]hepta-1,3,5-triene, 3-[2-(1-naphthalenyl)ethynyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 457.9±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 69.1±0.8 kJ/mol
Flash Point: 224.4±17.0 °C
Index of Refraction: 1.734
Molar Refractivity: 78.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.00
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8080.71
ACD/KOC (pH 5.5): 21804.34
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8080.71
ACD/KOC (pH 7.4): 21804.34
Polar Surface Area: 0 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 59.5±5.0 dyne/cm
Molar Volume: 196.9±5.0 cm3

Click to predict properties on the Chemicalize site


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